5-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazin-1-yl]-7-methoxy-quinoxaline

Systemtic Name: 5-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazin-1-yl]-7-methoxy-quinoxaline Openeye Name: 5-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazin-1-yl]-7-methoxy-quinoxaline CAS Name: 5-[4-[4-(5-isocyano-1-methyl-3-indolyl)cyclohexyl]-1-piperazinyl]-7-methoxyquinoxaline IUPAC Name: 5-[4-[4-(5-isocyano-1-methylindol-3-yl)cyclohexyl]piperazin-1-yl]-7-methoxyquinoxaline Traditional Name: 5-[4-[4-(5-isocyano-1-methyl-indol-3-yl)cyclohexyl]piperazino]-7-methoxy-quinoxaline Formula: C29H32N6O MolecularWeight: 480.60398

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=C1C=CC(=C2)[N+]#[C-])C3CCC(CC3)N4CCN(CC4)C5=C6C(=CC(=C5)OC)N=CC=N6

Isomeric SMILES

CN1C=C(C2=C1C=CC(=C2)[N+]#[C-])C3CCC(CC3)N4CCN(CC4)C5=C6C(=CC(=C5)OC)N=CC=N6

InChI

InChI=1S/C29H32N6O/c1-30-21-6-9-27-24(16-21)25(19-33(27)2)20-4-7-22(8-5-20)34-12-14-35(15-13-34)28-18-23(36-3)17-26-29(28)32-11-10-31-26/h6,9-11,16-20,22H,4-5,7-8,12-15H2,2-3H3